1-(1-propan-2-ylbenzotriazol-5-yl)sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-(1-propan-2-ylbenzotriazol-5-yl)sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-(1-isopropylbenzotriazol-5-yl)sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(1-propan-2-ylbenzotriazol-5-yl)sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-(1-isopropylbenzotriazol-5-yl)sulfonylproline Formula: C14H18N4O4S MolecularWeight: 338.38212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3C(=O)O)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3C(=O)O)N=N1

InChI

InChI=1S/C14H18N4O4S/c1-9(2)18-12-6-5-10(8-11(12)15-16-18)23(21,22)17-7-3-4-13(17)14(19)20/h5-6,8-9,13H,3-4,7H2,1-2H3,(H,19,20)